For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-(3,4-Dimethoxybenzylideneamino)-5-(4-isopropylthiazol-2-yl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 689WPoBJnlh
InChI InChI=1S/C17H19N5O2S2/c1-10(2)12-9-26-16(19-12)15-20-21-17(25)22(15)18-8-11-5-6-13(23-3)14(7-11)24-4/h5-10H,1-4H3,(H,21,25)/b18-8+
InChIKey CXEHQIKGPHKOHO-QGMBQPNBSA-N
Mol Weight 389.49 g/mol
Molecular Formula C17H19N5O2S2
Exact Mass 389.098017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 78T7VLggXI8
Name 4-(3,4-Dimethoxybenzylideneamino)-5-(4-isopropylthiazol-2-yl)-4H-1,2,4-triazole-3-thiol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19N5O2S2
InChI InChI=1S/C17H19N5O2S2/c1-10(2)12-9-26-16(19-12)15-20-21-17(25)22(15)18-8-11-5-6-13(23-3)14(7-11)24-4/h5-10H,1-4H3,(H,21,25)/b18-8+
InChIKey CXEHQIKGPHKOHO-QGMBQPNBSA-N
Molecular Weight 389.492 g/mol
SMILES Sc1[n](c(-c2nc(C(C)C)cs2)nn1)\N=C\c1cc(OC)c(cc1)OC
SPLASH splash10-000i-0009000000-08f96df0f8f629099735
Source of Spectrum F2-45-2071-6d
Synonyms 4-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-3-(4-propan-2-yl-2-thiazolyl)-1H-1,2,4-triazole-5-thione 4-[(E)-(3,4-dimethoxyphenyl)methyleneamino]-3-(4-isopropylthiazol-2-yl)-1H-1,2,4-triazole-5-thione 4-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-3-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-1,2,4-triazole-5-thione
Wiley ID 1688932